In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2009 | 21 | Yes |
Popular Name: (2S)-1-[3-[(2R)-2-methyl-1-piperidyl]propylamino]-3-morpholino-propan-2-ol (2S)-1-[3-[(2R)-2-methyl-1-piper…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 0.52 | 2.85 | -107.14 | 4 | 5 | 2 | 54 | 301.475 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.52 | 0.7 | -43.5 | 3 | 5 | 1 | 53 | 300.467 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.52 | 5.11 | -185.74 | 5 | 5 | 3 | 55 | 302.483 | 8 | ↓ |